CID 218147

3-(dimethylamino)-1-(1h-indol-3-yl)-2-phenylpropan-1-one

Structural Information

Molecular Formula
C19H20N2O
SMILES
CN(C)CC(C1=CC=CC=C1)C(=O)C2=CNC3=CC=CC=C32
InChI
InChI=1S/C19H20N2O/c1-21(2)13-17(14-8-4-3-5-9-14)19(22)16-12-20-18-11-7-6-10-15(16)18/h3-12,17,20H,13H2,1-2H3
InChIKey
NFLGRPGGSIWLGW-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-1-(1H-indol-3-yl)-2-phenylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.15756 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.16484 170.0
[M+Na]+ 315.14678 176.0
[M-H]- 291.15028 176.2
[M+NH4]+ 310.19138 186.0
[M+K]+ 331.12072 171.5
[M+H-H2O]+ 275.15482 161.4
[M+HCOO]- 337.15576 191.8
[M+CH3COO]- 351.17141 206.6
[M+Na-2H]- 313.13223 173.0
[M]+ 292.15701 170.8
[M]- 292.15811 170.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.